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Facile Preparation of (2Z,4E)-Dienamides by the Olefination of Electron-deficient Alkenes with Allyl Acetate
Published on: June 21, 2017
(E)-2-Meth-oxy-4-(3-oxobut-1-en-yl)phenyl acetate
Huoyun Zhang1, Shuqin Li, Xiaopeng Shi
1Department of Chemistry and Biology, Xiangfan University, Xiangfan 441053, People's Republic of China.
Acta Crystallographica. Section E, Structure Reports Online
|January 5, 2011
Summary
This study characterizes an α,β-unsaturated ketone, C(13)H(14)O(4), revealing its potential medicinal properties. Molecular analysis identified specific structural features and intermolecular interactions, including disorder in the ethenyl group.
Area of Science:
- Organic Chemistry
- Crystallography
- Medicinal Chemistry
Background:
- α,β-unsaturated ketones are a class of organic compounds.
- These compounds exhibit a range of potential biological activities, including bactericidal, fungicidal, anti-tumor, and anti-inflammatory effects.
Purpose of the Study:
- To characterize the molecular structure of the title compound, C(13)H(14)O(4).
- To investigate the potential medicinal properties suggested by its chemical class.
Main Methods:
- Single-crystal X-ray diffraction was used to determine the molecular and crystal structure.
- Analysis of atomic occupancies and intermolecular interactions was performed.
Main Results:
- The title compound, C(13)H(14)O(4), was structurally elucidated.
- Disorder was observed in the ethenyl group's carbon and hydrogen atoms, with occupancies of 0.583(7) and 0.417(3).
- Molecules form dimers through two intermolecular C-H⋯O interactions.
Conclusions:
- The structural characterization provides a foundation for understanding the compound's properties.
- The identified intermolecular interactions may influence crystal packing and solid-state behavior.
- Further research is warranted to explore the potential therapeutic applications of this α,β-unsaturated ketone.
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